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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03039433

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CIOCILOMILASTA,B1XOM0.74
CIOCILOMILASTA,B1XLX0.74
C61(2R,4S,5S,7S)-5-AMINO-N-BUTYL-4-
HYDROXY-7-[4-METHOXY-3-(3-METHOXYPROPOXY)BENZYL]-
2,8-DIMETHYLNONANAMIDE
C,O2V100.72
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.73
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
AGGTIROFIBANA,B2VDM0.7
HV8BENZYL-2-AMINO-PARAMETHOXY-BENZYLSTATINEC1A8G0.7
AB8(1S,3R,8AS)-8-(2-{(4S,6S)-3-(4-
HYDROXY-3-METHOXYBENZYL)-4-[2-(METHYLAMINO)-
2-OXOETHYL]-2-OXO-1,3-OXAZINAN-
6-YL}ETHYL)-3,7-DIMETHYL-1,2,3,7,8,8A-
HEXAHYDRONAPHTHALEN-1-YL (2R)-2-
METHYLBUTANOATE
A,B1XDG0.72
DAH3,4-DIHYDROXYPHENYLALANINEA,B1RNR0.72
DAH3,4-DIHYDROXYPHENYLALANINEA6PAH0.72
DAH3,4-DIHYDROXYPHENYLALANINEA,B1IVV0.72
CA2(1S,3R,4R,5S)-1,3,4-TRIHYDROXY-
5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID
A,B,C,D,E,F,
G,H,I,J,K,L
2BT40.71
TY33-HYDROXY-L-TYROSINEA,B2VH30.72
SHP(4-HYDROXYMALTOSEPHENYL)GLYCINEA1DSR0.78
C41ALISKIRENC,O2V0Z0.71
MAXMATAIRESINOLA2BGM0.72
T333,3'-DEIODO-THYROXINEA,B1THA0.72
VXXVANILLATEA,B1WB60.71
EMFethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylateA,B2QZZ0.75
EMFethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylateA,B2R2G0.75
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
142CARBIDOPAA,B1JS30.71
HWGN-(TERT-BUTYL)-3,5-DIMETHYL-N'-
[(5-METHYL-2,3-DIHYDRO-1,4-BENZODIOXIN-
6-YL)CARBONYL]BENZOHYDRAZIDE
A,D1R200.74
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.72
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.71
HXP3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACIDA1XAN0.72
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.71
AP1{3-[3-(3,4-DIMETHOXY-PHENYL)-1-
(1-{1-[2-(3,4,5-TRIMETHOXY-PHENYL)-
BUTYRYL]-PIPERIDIN-2YL}-VINYLOXY)-
PROPYL]-PHENOXY}-ACETIC ACID
A,B1BL40.71
DRS(9S,12S)-9-(1-methylethyl)-7,10-
dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca-
1(16),14,17-triene-12-carboxylic acid
A,B3BXS0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEX1Y0X0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK10.71
T443,5,3',5'-TETRAIODO-L-THYRONINEC,D1ICT0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA2RIW0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2ROX0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1IE40.71
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETB0.71
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETA0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B,C1SN00.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2CEO0.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1F860.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK40.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK20.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK50.71
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK30.71
FLTFLUOROMALONYL TYROSINEI1BZH0.73
D3P(2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
D3P(2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71